EMD335823 | 216584-50-8

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: EMD335823
• 英文别名: nitromethyl 2-trifluoromethoxyphenyl ketone；2-Nitro-1-(2-trifluoromethoxyphenyl)ethanone；2-nitro-1-[2-(trifluoromethoxy)phenyl]ethanone
• CAS: 216584-50-8
• 化学式: C₉H₆F₃NO₄
• 分子量: 249.146
• InChiKey: YATRFQSUJUXJHD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  17
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  72.1
• 氢给体数：
  0
• 氢受体数：
  7

文献信息

• New nitromethyl ketones, process for preparing them and compositions containing them
  申请人：Merck Patent GmbH

  公开号：US20030171422A1

  公开（公告）日：2003-09-11

  The present invention relates to the compounds of formula: 1 in which R 1 , R 2 , R 3 , E, A, X, Z, p and n are as defined herein. These compounds are aldose reductase inhibitors.

  本发明涉及公式1中的化合物：其中R1，R2，R3，E，A，X，Z，p和n的定义如本文所述。这些化合物是醛糖还原酶抑制剂。
• NITROMETHYL KETONES, PROCESS FOR PREPARING THEM AND COMPOSITIONS CONTAINING THEM
  申请人：——

  公开号：US20030069312A1

  公开（公告）日：2003-04-10

  The present invention relates to the compounds of formula: 1 in which R 1 , R 2 , R 3 , E, A, X, Z, p and n are as defined herein. These compounds are aldose reductase inhibitors.

  本发明涉及以下式子的化合物：1式中R1、R2、R3、E、A、X、Z、p和n的定义如本文所述。这些化合物是醛糖还原酶抑制剂。
• NEW NITROMETHYL KETONES, PROCESS FOR PREPARING THEM AND COMPOSITIONS CONTAINING THEM
  申请人：MERCK PATENT GmbH

  公开号：EP0983226A1

  公开（公告）日：2000-03-08
• METHOD FOR PREDICTING A SUBJECTS RESPONSE TO SLC MODULATOR THERAPY
  申请人：THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK

  公开号：US20210254158A1

  公开（公告）日：2021-08-19

  The present invention provides, inter alia, methods for treating or ameliorating the effects of a disorder, such as schizophrenia or bipolar disorder, by increasing or decreasing proline levels. Further provided are methods of predicting and monitoring the clinical response in a patient, and diagnostic systems for identifying a patient likely to benefit from proline modulation.
• US5932765A
  申请人：——

  公开号：US5932765A

  公开（公告）日：1999-08-03